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Frangula-emodin 2ME                  @
SpectraBase Compound ID 9OoH5XIf4Us
InChI InChI=1S/C17H14O5/c1-8-4-10-15(13(5-8)22-3)17(20)14-11(16(10)19)6-9(21-2)7-12(14)18/h4-7,18H,1-3H3
InChIKey UPIWKOZOBCLHSX-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C17H14O5
Exact Mass 298.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hyofpp9MCqy
Name 9,10-Anthracenedione, 1-hydroxy-3,8-dimethoxy-6-methyl-
CAS Registry Number 23610-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O5
InChI InChI=1S/C17H14O5/c1-8-4-10-15(13(5-8)22-3)17(20)14-11(16(10)19)6-9(21-2)7-12(14)18/h4-7,18H,1-3H3
InChIKey UPIWKOZOBCLHSX-UHFFFAOYSA-N
Molecular Weight 298.294 g/mol
SMILES Oc1cc(cc2c1C(c1c(cc(C)cc1OC)C2=O)=O)OC
SPLASH splash10-0f7t-0790000000-3a48dbf5d9a478ca8f86
Source of Spectrum T-68-3762-0
Synonyms 1-Hydroxy-3,8-dimethoxy-6-methylanthra-9,10-quinone 1,6-Di-O-methylemodin 1,6-Dimethoxy-3-methyl-8-oxidanyl-anthracene-9,10-dione 1-Hydroxy-3,8-dimethoxy-6-methyl-9,10-anthraquinone 1-Hydroxy-3,8-dimethoxy-6-methyl-anthracene-9,10-dione Anthraquinone, 1-hydroxy-3,8-dimethoxy-6-methyl- Emodin 1,6-dimethyl ether Physcion-monomethylether
Wiley ID 44110